Glycoside
GD091222
Name:
NoneFormula:
C18H26O7N6Smiles:
COC(=O)[C@@H](NC(=O)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OC)C(C)CAglycone:
COC(=O)C(NC(=O)Nc1ncnc2c1N=C[N]2)C(C)CSugarmoiety:
COC1C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.61 |
| AlogP: | -0.59 | Num_rotatable_bonds: | 7 |
| MolWt: | 438.44 | Num_heavy_atoms: | 31 |
| TPSA: | 169.95 | NumAromaticRings: | 2 |
Unique Aglycone
AD36943
Formula: C12H15O3N6
Smiles:
COC(=O)C(NC(=O)Nc1ncnc2c1N=C[N]2)C(C)C| HBA: | 9 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.42 |
| AlogP: | 0.7 | Num_rotatable_bonds: | 4 |
| MolWt: | 291.29 | Num_heavy_atoms: | 21 |
| TPSA: | 119.67 | NumAromaticRings: | 1 |
